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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1282734
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Mg', 'O', 'Si', 'Ti']
  • Chemical System: Mg-O-Si-Ti
  • Density: 3.945710188602144
  • Atomic Density: 0.10681821963419402
  • Unit Cell Volume: 748.9359050727978
  • Molar Volume: 5.637746800707983
  • Full Formula: Mg12 Ti8 Si12 O48
  • Reduced Formula: Mg3Ti2(SiO4)3
  • Formula Anonymous: A2B3C3D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m